%chk=000205547.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205547

0 1
O -3.509775 1.433516 -1.598089
N -1.113924 1.031555 1.153851
C -1.396093 -0.366301 1.592176
C 0.249088 1.526783 1.498704
C -1.497931 1.293264 -0.262924
C -0.976690 -1.493135 0.675807
C 1.377636 1.213401 0.542777
C 1.468562 -1.210409 1.309421
C 0.360375 -1.917052 0.572130
C 1.969123 -0.061073 0.472879
C -2.991039 1.703674 -0.283679
C -1.964985 -2.152380 -0.073028
C 1.868841 2.243035 -0.276035
C 0.683453 -3.002775 -0.258168
C 3.037847 -0.283121 -0.411185
C -3.209712 3.164760 0.087319
C -1.637177 -3.228311 -0.899599
C 2.930872 2.015684 -1.152827
C -0.309372 -3.658046 -0.987944
C 3.517750 0.748205 -1.219547
H -0.949040 -0.519885 2.601350
H -2.501924 -0.406999 1.753973
H 0.141020 2.634515 1.606335
H 0.512780 1.160407 2.518161
H -0.870612 2.098541 -0.696412
H -1.355385 0.413000 -0.931070
H 1.120405 -0.855965 2.303453
H 2.295484 -1.914284 1.542027
H -3.610293 1.023480 0.345669
H -3.000842 -1.816108 -0.015851
H 1.419054 3.233986 -0.226257
H 1.717584 -3.331844 -0.339914
H 3.492102 -1.270664 -0.471757
H -4.272362 3.429427 0.031781
H -2.664456 3.851709 -0.566367
H -2.869122 3.351159 1.115251
H -2.413323 -3.728486 -1.475471
H 3.301102 2.822429 -1.781860
H -0.049425 -4.498620 -1.628490
H 4.345944 0.565268 -1.901615
H -3.145141 2.046058 -2.260575


%chk=000205547-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205547

0 1
O -3.703087 1.967436 -1.656302
N -1.152909 0.896176 0.936736
C -1.492322 -0.442382 1.466282
C 0.112948 1.540837 1.343690
C -1.698506 1.227009 -0.390414
C -1.002593 -1.648391 0.651861
C 1.347667 1.255920 0.477252
C 1.460304 -1.193837 1.294281
C 0.376718 -2.007355 0.581518
C 1.983243 -0.022038 0.458814
C -3.084274 1.923810 -0.311174
C -1.951798 -2.427231 -0.056928
C 1.873441 2.295903 -0.330228
C 0.755510 -3.136166 -0.185716
C 3.120287 -0.212313 -0.364019
C -3.018897 3.319672 0.325953
C -1.563351 -3.544421 -0.829661
C 3.001560 2.093573 -1.156570
C -0.199001 -3.902682 -0.891296
C 3.629559 0.829022 -1.172228
H -1.108465 -0.494609 2.503752
H -2.596172 -0.512647 1.541480
H -0.045574 2.638118 1.353256
H 0.306710 1.247519 2.393993
H -0.990124 1.891217 -0.927265
H -1.811481 0.320363 -1.020437
H 1.075944 -0.820998 2.261655
H 2.307443 -1.864829 1.526826
H -3.778128 1.282274 0.260905
H -3.013005 -2.152699 0.002282
H 1.395049 3.283842 -0.299801
H 1.814666 -3.419594 -0.228313
H 3.617194 -1.190600 -0.367850
H -4.026105 3.766634 0.390460
H -2.375449 3.996972 -0.271712
H -2.595182 3.249686 1.343875
H -2.315469 -4.127649 -1.372425
H 3.388478 2.912453 -1.773375
H 0.119457 -4.770593 -1.479627
H 4.509850 0.655822 -1.801356
H -3.173740 2.585176 -2.223773


